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(3'R,5'S)-3'-Hydroxycotinine Acetate CAS NO 111034-55-0
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CAS No.:111034-55-0
Grade:Pharmacy Grade
Content:99.9%
Brand:Customizable
Packaging:Customizable
Description
(3'R,5'S)-3'-Hydroxycotinine Acetate is a high-purity, stereochemically defined metabolite of cotinine, a primary nicotine derivative. This compound is of significant value as a critical reference standard and analytical intermediate in pharmaceutical and toxicological research. It is primarily required by research institutions, diagnostic laboratories, and pharmaceutical companies engaged in nicotine metabolism studies, biomarker development, and forensic analysis.
Application
- Pharmaceutical Reference Standard: Used as a certified reference material (CRM) for the quantification of nicotine metabolites in biological samples via LC-MS/MS or HPLC.
- Biomarker Research: Essential for studying human nicotine metabolism, pharmacokinetics, and for validating analytical methods in clinical and pre-clinical trials.
- Diagnostic Kit Development: Serves as a key calibrant in the manufacture of immunoassay kits for nicotine exposure testing and smoking cessation monitoring.
- Forensic Toxicology: Employed as an analytical standard in forensic labs to accurately determine nicotine intake and exposure levels.
- Metabolic Pathway Studies: A crucial intermediate for investigating specific enzymatic pathways involved in cotinine and nicotine processing.
- Chemical Synthesis: Acts as a chiral building block or precursor for the synthesis of more complex nicotine analogs and labeled compounds for tracer studies.
Basic Information
| Product Name | (3'R,5'S)-3'-Hydroxycotinine Acetate |
| CAS No. | 111034-55-0 |
| Molecular Formula | C12H14N2O3 |
| Molecular Weight | 234.25 g/mol |
| Synonyms | trans-3'-Hydroxycotinine Acetate; (3R,5S)-3-Hydroxycotinine Acetate; 1-Methyl-5-(3-pyridyl)-2-pyrrolidinone-3-acetate; 3'-Hydroxycotinine 3-Acetate; Nicotine Metabolite Acetate; Cotinine Hydroxy Metabolite Acetate; (R,S)-3'-Hydroxycotinine Acetate (stereoisomer mixture); 5-(3-Pyridyl)-1-methyl-2-pyrrolidinone-3-yl acetate |
| EINECS | Contact for details |
Quality Control
Our (3'R,5'S)-3'-Hydroxycotinine Acetate is manufactured under strict quality management systems. Each batch undergoes comprehensive analytical testing, including chiral purity verification by HPLC, to ensure identity, potency, and freedom from critical impurities. Certificates of Analysis (COA) detailing lot-specific results for assay, chiral purity, and related substances are available upon request.
Storage
Preserve in a tightly closed container, protected from light. Store at controlled room temperature (15-25°C) in a dry environment. For long-term storage, consider storing under inert atmosphere at -20°C.
Specification
| Item | Specification |
|---|---|
| Appearance | White to off-white solid |
| Identification (IR) | Conforms to structure |
| Identification (HPLC) | Retention time matches reference standard |
| Assay (HPLC) | ≥98.0% |
| Chiral Purity (Chiral HPLC) | ≥99.0% (3'R,5'S isomer) |
| Related Substances (HPLC) | Total impurities ≤2.0% |
| Any single unknown impurity | ≤0.5% |
| Residual Solvents (GC) | Complies with ICH guidelines |
| Water Content (KF) | ≤0.5% |
Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.
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